2-[6-(Dimethylamino)-2-methylsulfanylpyrimidin-4-yl]ethanol | 934365-78-3

• 分子结构分类: 有机化合物 - 有机硫化合物 - 硫醚类
• 英文名称: 2-[6-(Dimethylamino)-2-methylsulfanylpyrimidin-4-yl]ethanol
• CAS: 934365-78-3
• 化学式: C₉H₁₅N₃OS
• 分子量: 213.304
• InChiKey: RPINIYXTMNWNER-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.1
• 重原子数：
  14
• 可旋转键数：
  4
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.56
• 拓扑面积：
  74.6
• 氢给体数：
  1
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  2-[6-(Dimethylamino)-2-methylsulfanylpyrimidin-4-yl]ethanol 在 sodium hydride 作用下， 以 1,4-二氧六环 为溶剂， 反应 3.0h， 以45%的产率得到4-Pyrimidinamine, 6-ethenyl-N,N-dimethyl-2-(methylthio)-
  参考文献：
  名称：

  WO2007/43094

  摘要：

  公开号：
• 作为产物：
  描述：

  2-methylthio-6-[(2'-hydroxy)ethan-1'-yl]-4(3H)-pyrimidinone 在 4-二甲氨基吡啶 作用下， 以 四氢呋喃 、 二氯甲烷 为溶剂， 反应 72.0h， 生成 2-[6-(Dimethylamino)-2-methylsulfanylpyrimidin-4-yl]ethanol
  参考文献：
  名称：

  Synthesis and biological evaluation of 4-alkylamino-6-(2-hydroxyethyl)-2-methylthiopyrimidines as new rubella virus inhibitors

  摘要：

  In the search for new chemotherapeutic agents useful against Rubella virus (RV) infections, a solution-phase parallel approach for the synthesis of a small library of 4-alkylamino-6-(2-hydroxyethyl)-2-methylthiopyrimidines has been set up, based on previous results from our research group. Biological evaluation of the newly synthesized compounds pointed out their interesting properties as anti-RV agents with IC50 values in the micromolar range. (c) 2006 Elsevier Masson SAS. All rights reserved.

  DOI：

  10.1016/j.ejmech.2006.09.002

文献信息

• WO2007/43094
  申请人：——

  公开号：——

  公开（公告）日：——
• Synthesis and biological evaluation of 4-alkylamino-6-(2-hydroxyethyl)-2-methylthiopyrimidines as new rubella virus inhibitors
  作者：Claudia Mugnaini、Elena Petricci、Maurizio Botta、Federico Corelli、Paola Mastromarino、Gianluca Giorgi

  DOI：10.1016/j.ejmech.2006.09.002

  日期：2007.2

  In the search for new chemotherapeutic agents useful against Rubella virus (RV) infections, a solution-phase parallel approach for the synthesis of a small library of 4-alkylamino-6-(2-hydroxyethyl)-2-methylthiopyrimidines has been set up, based on previous results from our research group. Biological evaluation of the newly synthesized compounds pointed out their interesting properties as anti-RV agents with IC50 values in the micromolar range. (c) 2006 Elsevier Masson SAS. All rights reserved.